Geometry & MOs

Info

ID:	175470
PubChem CID:	75909506
Reduced:	N3O4C23H36 (1)
Stoich.:	A3B4C23D36 (1)
Weight, g/mol:	417.262757
ΔH_f, kcal/mol:	-141.24
Dipole, Da:	7.56
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.753384
Charge, e:	0

Chem-info

IUPAC name:

3-ethoxy-N-(1-ethylpiperidin-3-yl)-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide

Drug info:

PubChemData

Smile

CC[NH+]1CCCC(C1)NC(=O)C2=CC(=C(C=C2)OCC(=O)N3CCCCC3)OCC

DOS

IR

Vibrations